A tight-binding study of the electron transport through single-walled carbon nanotube-graphene hybrid nanostructures.

Hybrid carbon nanostructures based on the sp hybridized allotropes of carbon, such as graphene and single-walled carbon nanotubes (SWCNTs), hold vast potential for applications in electronics of various forms. Electronic properties of such hybrid structures are modified due to the interaction between atoms of the components, which can be utilized to tailor the properties of the hybrid structures to suite the application. In this study, we have explored charge (electron) transport through the hybrid structures of single-layer graphene (SLG) and SWCNTs (both metallic and semiconducting) using the nonequilibrium Green's function formalism within the framework of tight-binding density functional theory. Our calculations show that the electronic transport in hybrid nanostructures is affected by the interactions between SWCNT and SLG in comparison to the individual components. The changes in the electronic structure and the transport properties with increasing interaction in hybrids (captured by decreasing the separation between SWCNT and SLG) are discussed, and it is demonstrated from this analysis that the hybrids with semiconducting SWCNTs and metallic SWCNTs show different behavior in the low bias regime while they show similar behavior at higher biases. The difference in the transport properties of hybrids with semiconducting and metallic SWCNTs is explained in terms of changes in the electronic structure, the local density of states, and the energy dispersion for electrons due to the interaction between atoms of the two components.